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Information card for entry 2232943
Preview
Coordinates | 2232943.cif |
---|---|
Structure factors | 2232943.hkl |
Original IUCr paper | HTML |
Chemical name | Tetra-μ-acetato-κ^8^<i>O</i>:<i>O</i>'-bis{[2,2-dimethyl-<i>N</i>-(pyridin-2-yl)propanamide-κ<i>N</i>^1^]copper(II)}(<i>Cu</i>—<i>Cu</i>) |
---|---|
Formula | C28 H40 Cu2 N4 O10 |
Calculated formula | C28 H40 Cu2 N4 O10 |
SMILES | C1(C)=[O][Cu]234([n]5ccccc5NC(=O)C(C)(C)C)[O]=C(C)O[Cu]4([n]4ccccc4NC(=O)C(C)(C)C)(O1)([O]=C(C)O3)[O]=C(O2)C |
Title of publication | Tetra-μ-acetato-κ^8^<i>O</i>:<i>O</i>'-bis{[2,2-dimethyl-<i>N</i>-(pyridin-2-yl)propanamide-κ<i>N</i>^1^]copper(II)}(<i>Cu</i>—<i>Cu</i>) |
Authors of publication | Asem, Samuel; Buchanan, Robert M.; Mashuta, Mark S. |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2011 |
Journal volume | 67 |
Journal issue | 12 |
Pages of publication | m1892 - m1893 |
a | 13.8508 ± 0.0008 Å |
b | 11.0612 ± 0.0005 Å |
c | 11.0301 ± 0.0006 Å |
α | 90° |
β | 104.508 ± 0.006° |
γ | 90° |
Cell volume | 1636 ± 0.16 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0432 |
Residual factor for significantly intense reflections | 0.0345 |
Weighted residual factors for significantly intense reflections | 0.0895 |
Weighted residual factors for all reflections included in the refinement | 0.0938 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.014 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2232943.html
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Users of the data should acknowledge the original authors of the
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